6MN
Summary
| Name: | 2-amino-2-deoxy-6-O-phosphono-alpha-D-mannopyranose |
| Synonyms: | Mannosamine-6-phosphate 6-O-phosphono-alpha-D-mannosamine; 2-amino-2-deoxy-6-O-phosphono-alpha-D-mannose; 2-amino-2-deoxy-6-O-phosphono-D-mannose; 2-amino-2-deoxy-6-O-phosphono-mannose |
| Formula: | C6 H14 N O8 P |
| Formal charge: | 0 |
| Formula weight: | 259.151 Da |
| Component type: | D-saccharide, alpha linking |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 2-amino-2-deoxy-6-O-phosphono-alpha-D-mannopyranose |
| OpenEye OEToolkits | 1.5.0 | [(2R,3S,4R,5S,6S)-5-amino-3,4,6-trihydroxy-oxan-2-yl]methyl dihydrogen phosphate |
| PDB-CARE | 1.0 | a-D-ManpN6PO3 |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=P(O)(O)OCC1OC(O)C(N)C(O)C1O |
| SMILES_CANONICAL | CACTVS | 3.341 | N[C@@H]1[C@@H](O)O[C@H](CO[P](O)(O)=O)[C@@H](O)[C@@H]1O |
| SMILES | CACTVS | 3.341 | N[CH]1[CH](O)O[CH](CO[P](O)(O)=O)[CH](O)[CH]1O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C([C@@H]1[C@H]([C@@H]([C@@H]([C@H](O1)O)N)O)O)OP(=O)(O)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | C(C1C(C(C(C(O1)O)N)O)O)OP(=O)(O)O |
| InChI | InChI | 1.03 | InChI=1S/C6H14NO8P/c7-3-5(9)4(8)2(15-6(3)10)1-14-16(11,12)13/h2-6,8-10H,1,7H2,(H2,11,12,13)/t2-,3+,4-,5-,6+/m1/s1 |
| InChIKey | InChI | 1.03 | XHMJOUIAFHJHBW-RXRWUWDJSA-N |
